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Chemical ID: 7510209
Chemical ID:
7510209
Name [?]:
3-chloro-4-ethoxy-N-(4-propanoylaminophenyl)-benzamide
SMILES [?]:
CCC(=O)Nc1ccc(cc1)NC(=O)c2ccc(c(c2)Cl)OCC
InChi [?]:
InChI=1/C18H19ClN2O3/c1-3-17(22)20-13-6-8-14(9-7-13)21-18(23)12-5-10-16(24-4-2)15(19)11-12/h5-11H,3-4H2,1-2H3,(H,20,22)(H,21,23)
InChi Info:
AuxInfo=1/1/N:1,24,2,23,16,7,11,8,10,17,20,15,6,9,19,18,3,13,21,5,12,4,14,22/E:(6,7)(8,9)/rA:24nCCCONCCCCCCNCOCCCCCCClOCC/rB:s1;s2;d3;s3;s5;s6;d7;s8;d9;d6s10;s9;s12;d13;s13;s15;d16;s17;d18;d15s19;s19;s18;s22;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C18H19ClN2O3 |
All Atoms: | 43 |
Heavy Atoms: | 24 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 9.78291 |
Area: | 574.381 |
Solvation: | -4.57661 |
Coulombic: | -48.2883 |
Bond Count [?]
All: | 25 |
Single: | 17 |
Double: | 8 |
Rotors: | 8 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 3.04 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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